(5Z)-2-methyl-5-trimethylsilylhepta-1,5-dien-3-ol

C11H22OSi — CID 13023699

IUPAC(5Z)-2-methyl-5-trimethylsilylhepta-1,5-dien-3-ol
SMILESC=C(C)C(O)C/C(=C/C)[Si](C)(C)C
InChIInChI=1S/C11H22OSi/c1-7-10(13(4,5)6)8-11(12)9(2)3/h7,11-12H,2,8H2,1,3-6H3/b10-7-
InChIKeyYPKCISAVSTXHLK-YFHOEESVSA-N
MW198.38 g/mol
LogP3.14
Rot. Bonds4

About (5Z)-2-methyl-5-trimethylsilylhepta-1,5-dien-3-ol

(5Z)-2-methyl-5-trimethylsilylhepta-1,5-dien-3-ol (PubChem CID 13023699) has the molecular formula C11H22OSi and a molecular weight of 198.38 g/mol. Its IUPAC name is (5Z)-2-methyl-5-trimethylsilylhepta-1,5-dien-3-ol.

Molecular Properties

Compound Name(5Z)-2-methyl-5-trimethylsilylhepta-1,5-dien-3-ol
PubChem CID13023699
Molecular FormulaC11H22OSi
Molecular Weight198.38 g/mol
Exact Mass198.14
IUPAC Name(5Z)-2-methyl-5-trimethylsilylhepta-1,5-dien-3-ol
SMILESC=C(C)C(O)C/C(=C/C)[Si](C)(C)C
InChIInChI=1S/C11H22OSi/c1-7-10(13(4,5)6)8-11(12)9(2)3/h7,11-12H,2,8H2,1,3-6H3/b10-7-
InChIKeyYPKCISAVSTXHLK-YFHOEESVSA-N
XLogP3.14
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.38
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (5Z)-2-methyl-5-trimethylsilylhepta-1,5-dien-3-ol?
The IUPAC name of (5Z)-2-methyl-5-trimethylsilylhepta-1,5-dien-3-ol (CID 13023699) is (5Z)-2-methyl-5-trimethylsilylhepta-1,5-dien-3-ol.
What is the SMILES notation for (5Z)-2-methyl-5-trimethylsilylhepta-1,5-dien-3-ol?
The canonical SMILES for (5Z)-2-methyl-5-trimethylsilylhepta-1,5-dien-3-ol is C=C(C)C(O)C/C(=C/C)[Si](C)(C)C.
What is the InChIKey of (5Z)-2-methyl-5-trimethylsilylhepta-1,5-dien-3-ol?
The InChIKey is YPKCISAVSTXHLK-YFHOEESVSA-N. The full InChI is InChI=1S/C11H22OSi/c1-7-10(13(4,5)6)8-11(12)9(2)3/h7,11-12H,2,8H2,1,3-6H3/b10-7-.
What are the key properties of (5Z)-2-methyl-5-trimethylsilylhepta-1,5-dien-3-ol?
(5Z)-2-methyl-5-trimethylsilylhepta-1,5-dien-3-ol has a molecular weight of 198.38 g/mol, XLogP of 3.14, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-2-methyl-5-trimethylsilylhepta-1,5-dien-3-ol is sourced from PubChem (CID 13023699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).